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Updated: Jul 11, 2025

Ion Mobility-Mass Spectrometry Techniques for Determining the Structure and Mechanisms of Metal Ion Recognition and Redox Activity of Metal Binding Oligopeptides
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Ion Mobility-Mass Spectrometry Techniques for Determining the Structure and Mechanisms of Metal Ion Recognition and Redox Activity of Metal Binding Oligopeptides

Published on: September 7, 2019

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G0W0 第一排过渡金属水离子的电离潜力

Daniel Mejia-Rodriguez1,2, Alexander A Kunitsa3, John L Fulton2

  • 1Environmental Molecular Sciences Laboratory, Pacific Northwest National Laboratory, Richland, Washington 99352, United States.

The journal of physical chemistry. A
|November 8, 2023
PubMed
概括

这项研究使用GW近似计算了第一排过渡金属水离子的垂直电离潜力. 结果显示与实验有很好的一致性,特别是与G0W0@PBE0和G0W0@r2SCAN方法.

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